Chemical Properties of Succinic acid, 2-fluorophenyl 4-chlorobenzyl ester

InChI

InChI=1S/C17H14ClFO4/c18-13-7-5-12(6-8-13)11-22-16(20)9-10-17(21)23-15-4-2-1-3-14(15)19/h1-8H,9-11H2

InChI Key

CTFFCTSXVAKIGY-UHFFFAOYSA-N

Formula

C17H14ClFO4

SMILES

O=C(CCC(=O)Oc1ccccc1F)OCc1ccc(Cl)cc1

Molecular Weight¹

336.74

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-376.76	kJ/mol	Joback Calculated Property
ΔfH°gas	-645.54	kJ/mol	Joback Calculated Property
ΔfusH°	39.94	kJ/mol	Joback Calculated Property
ΔvapH°	81.19	kJ/mol	Joback Calculated Property
log10WS	-5.03		Crippen Calculated Property
logPoct/wat	3.908		Crippen Calculated Property
McVol	231.760	ml/mol	McGowan Calculated Property
Pc	2051.17	kPa	Joback Calculated Property
Inp	[2505.00; 2505.00]
Inp	2505.00		NIST
Inp	2505.00		NIST
Tboil	840.96	K	Joback Calculated Property
Tc	1068.17	K	Joback Calculated Property
Tfus	534.06	K	Joback Calculated Property
Vc	0.886	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[641.78; 695.73]	J/mol×K	[840.96; 1068.17]
Cp,gas	641.78	J/mol×K	840.96	Joback Calculated Property
Cp,gas	653.54	J/mol×K	878.83	Joback Calculated Property
Cp,gas	664.15	J/mol×K	916.70	Joback Calculated Property
Cp,gas	673.66	J/mol×K	954.56	Joback Calculated Property
Cp,gas	682.07	J/mol×K	992.43	Joback Calculated Property
Cp,gas	689.42	J/mol×K	1030.30	Joback Calculated Property
Cp,gas	695.73	J/mol×K	1068.17	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenyl 4-chlorobenzyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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